3-[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannyl-thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]phenyl]sulfanylpropanenitrile

Systemtic Name: 3-[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannyl-thiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]phenyl]sulfanylpropanenitrile Openeye Name: 3-[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannyl-2-thienyl)-2-thienyl]-2-thienyl]-2-thienyl]-2-thienyl]-2-thienyl]phenyl]sulfanylpropanenitrile CAS Name: 3-[[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannyl-2-thiophenyl)-2-thiophenyl]-2-thiophenyl]-2-thiophenyl]-2-thiophenyl]-2-thiophenyl]phenyl]thio]propanenitrile IUPAC Name: 3-[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]phenyl]sulfanylpropanenitrile Traditional Name: 3-[[4-[4-hexyl-5-[4-hexyl-5-[5-[5-[3-hexyl-5-(3-hexyl-5-tributylstannyl-2-thienyl)-2-thienyl]-2-thienyl]-2-thienyl]-2-thienyl]-2-thienyl]phenyl]thio]propionitrile Formula: C69H95NS7Sn MolecularWeight: 1281.6643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(SC(=C1)C2=CC=C(C=C2)SCCC#N)C3=CC(=C(S3)C4=CC=C(S4)C5=CC=C(S5)C6=C(C=C(S6)C7=C(C=C(S7)[Sn](CCCC)(CCCC)CCCC)CCCCCC)CCCCCC)CCCCCC

Isomeric SMILES

CCCCCCC1=C(SC(=C1)C2=CC=C(C=C2)SCCC#N)C3=CC(=C(S3)C4=CC=C(S4)C5=CC=C(S5)C6=C(C=C(S6)C7=C(C=C(S7)[Sn](CCCC)(CCCC)CCCC)CCCCCC)CCCCCC)CCCCCC

InChI

InChI=1S/C57H68NS7.3C4H9.Sn/c1-5-9-13-17-22-42-34-37-60-54(42)52-39-44(24-19-15-11-7-3)55(64-52)49-32-30-47(61-49)48-31-33-50(62-48)56-45(25-20-16-12-8-4)40-53(65-56)57-43(23-18-14-10-6-2)38-51(63-57)41-26-28-46(29-27-41)59-36-21-35-58;3*1-3-4-2;/h26-34,38-40H,5-25,36H2,1-4H3;3*1,3-4H2,2H3;